Hybrid-DFT Modeling of Lattice and Surface Vacancies in MnO-Reference-Cited by-同舟云学术

Hybrid-DFT Modeling of Lattice and Surface Vacancies in MnO

Published:2018-11-14 Issue:13 Volume:123 Page:8133-8144
ISSN:1932-7447
Container-title:The Journal of Physical Chemistry C
language:en
Short-container-title:J. Phys. Chem. C

Author:

Logsdail Andrew J.¹^ORCID,Downing Christopher A.²³,Keal Thomas W.³^ORCID,Sherwood Paul³,Sokol Alexey A.²^ORCID,Catlow C. Richard A.¹²⁴

Affiliation:

1. Cardiff Catalysis Institute, School of Chemistry, Cardiff University, Cardiff, CF10 3AT, United Kingdom

2. Kathleen Lonsdale Materials Chemistry, Department of Chemistry, University College London, 20 Gordon Street, London, WC1H 0AJ, United Kingdom

3. Scientific Computing Department, STFC Daresbury Laboratory, Daresbury, Warrington, WA4 4AD, United Kingdom

4. UK Catalysis Hub, Research Complex at Harwell, Science and Technology Facilities Council Rutherford Appleton Laboratory, Harwell Science and Innovation Campus, Oxon, OX11 0QX, United Kingdom

Funder

Engineering and Physical Sciences Research Council

Science and Technology Facilities Council

Ramsay Memorial Fellowships Trust, University College London

Publisher

American Chemical Society (ACS)

Subject

Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials

Link

http://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.8b07846

Reference103 articles.

1. Oxide surfaces as environmental interfaces

2. Quantitative Structural Studies Of Corundum and Rocksalt Oxide Surfaces

3. Physics and Chemistry at Oxide Surfaces

4. Oxygen Vacancy: The Invisible Agent on Oxide Surfaces

5. Efficient green methanol synthesis from glycerol

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